ChemSpider 2D Image | (2E)-2-(4-Butoxy-3-ethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone | C23H26O3

(2E)-2-(4-Butoxy-3-ethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone

  • Molecular FormulaC23H26O3
  • Average mass350.451 Da
  • Monoisotopic mass350.188202 Da
  • ChemSpider ID22947334

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2E)-2-(4-Butoxy-3-ethoxybenzyliden)-3,4-dihydro-1(2H)-naphthalinon [German] [ACD/IUPAC Name]
(2E)-2-(4-Butoxy-3-éthoxybenzylidène)-3,4-dihydro-1(2H)-naphtalénone [French] [ACD/IUPAC Name]
(2E)-2-(4-Butoxy-3-ethoxybenzylidene)-3,4-dihydro-1(2H)-naphthalenone [ACD/IUPAC Name]
1(2H)-Naphthalenone, 2-[(4-butoxy-3-ethoxyphenyl)methylene]-3,4-dihydro-, (2E)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 510.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 255.0±16.5 °C
Index of Refraction: 1.587
Molar Refractivity: 105.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.80
ACD/LogD (pH 5.5): 5.58
ACD/BCF (pH 5.5): 10304.99
ACD/KOC (pH 5.5): 25949.49
ACD/LogD (pH 7.4): 5.58
ACD/BCF (pH 7.4): 10304.99
ACD/KOC (pH 7.4): 25949.49
Polar Surface Area: 36 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 314.6±3.0 cm3

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